8008-8275 Screening compound: 10,10-dimethyl-10a-[(1E)-2-(4-methylphenyl)ethenyl]-1H,2H,3H,4H,10H,10aH-pyrimido[1,2-a]indol-2-one

8008-8275 Screening compound: 10,10-dimethyl-10a-[(1E)-2-(4-methylphenyl)ethenyl]-1H,2H,3H,4H,10H,10aH-pyrimido[1,2-a]indol-2-one
8008-8275 Screening compound: 10,10-dimethyl-10a-[(1E)-2-(4-methylphenyl)ethenyl]-1H,2H,3H,4H,10H,10aH-pyrimido[1,2-a]indol-2-one alternative view

Chemical Structure Depiction of ChemDiv screening compound 8008-8275
10,10-dimethyl-10a-[(1E)-2-(4-methylphenyl)ethenyl]-1H,2H,3H,4H,10H,10aH-pyrimido[1,2-a]indol-2-one

Available from 1 mg

Formats:

  • Glass Vials (4ml Glass Vials VWR #97047-678)
  • 96-tube racks (Matrix #4247 96-well 1.4ml sealed with capmats, empty cols 1 & 12, 100uL of 10mM)

Shiptime: 1 week worldwide delivery in most cases

Compound Identifiers

ChemDiv Compound ID

8008-8275

Molecular Formula

C22H24N2O (C22 H24 N2 O)

Compound Name

10,10-dimethyl-10a-[(1E)-2-(4-methylphenyl)ethenyl]-1H,2H,3H,4H,10H,10aH-pyrimido[1,2-a]indol-2-one

IUPAC name

1010-dimethyl-10a-[(1E)-2-(4-methylphenyl)ethenyl]-1H2H3H4H10H10aH-pyrimido[12-a]indol-2-one

SMILES

CC1(C)c(cccc2)c2N(CC2)C1(/C=C/c1ccc(C)cc1)NC2=O

InChI

InChI=1S/C22H24N2O/c1-16-8-10-17(11-9-16)12-14-22-21(2,3)18-6-4-5-7-19(18)24(22)15-13-20(25)23-22/h4-12,14H,13,15H2,1-3H3,(H,23,25)/t22-/m1/s1

InChI Key

RGBIEZDHXWWMHW-JOCHJYFZSA-N

MDL Number (MFCD)

MFCD01460109

Chemical and Physical Properties

Saltdata

n/a

Molecular Weight

332.45

Hydrogen Bond Acceptors Count

2.00

Hydrogen Bond Donors Count

1.00

Rotatable Bond Count

2.00

Number of Nitrogen and Oxygen Atoms

3

Partition Coefficient, logP

4.745

Distribution Coefficient, logD

4.745

Water Solubility, LogSw

-4.38

Polar Surface Area

28.333

Acid Dissociation Constant (pKa)

11.20

Base Dissociation Constant (pKb)

-0.52

Number of Chiral Centers

1.00

Percent sp3 carbon bonding

31.80

8008-8275 in Drug Discovery

Included in Screening Libraries

Antiparasite Library (23996 compounds)

MCE-18 Trends in Medicinal Chemistry (51288 compounds)

Included in 1.7M Stock Database

Therapeutical areas:
  • Infections
  • Immune system
  • animal
Agro:
  • Agro

References: we are preparing a list of scientific research reports with 8008-8275 chemical compound. It will be published here after verification.

Frequently Asked Questions

How to purchase chemical compound 8008-8275?
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What is the minimum amount of 8008-8275 you sell to drug discovery company or institution?
Available from 1 mg in Glass Vials or 96-tube racks.
Delivery options for 8008-8275
ChemDiv sends parcels with Express services (UPS, WC).
  • 1–2 days for small orders
  • 2–4 weeks for large selections
Delivery formats for 8008-8275
  • 0.5–50 mg of dry powder sample in single glass vials, custom vials
  • DMSO solutions frozen 10μl–250μl@10mM (96 and 384 format)

Custom synthesis of 8008-8275 available by request